element(s):
['Al', 'Li']
AFLOW prototype label:
AB_hP8_194_bc_f
Parameter names:
['a', 'c/a', 'z3']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['4.466', '1.9322436', '0.58348746']
model name:
MEAM_LAMMPS_RoyDuttaChakraborti_2021_AlLi__MO_971738391444_001
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Al', 'Li']
representative atom coordinates =  [[0.         0.         0.25      ]
 [0.33333333 0.66666667 0.25      ]
 [0.33333333 0.66666667 0.58348746]]
spacegroup =  194
cell =  [[4.466, 0, 0], [-2.233, 3.8676694533013, 0], [0, 0, 8.6294]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 12:12:48      -17.993850         0.261662
BFGS:    1 12:12:48      -17.998402         0.250176
BFGS:    2 12:12:48      -18.042100         0.158161
BFGS:    3 12:12:48      -18.052883         0.204702
BFGS:    4 12:12:48      -18.053703         0.201349
BFGS:    5 12:12:48      -18.064938         0.162370
BFGS:    6 12:12:48      -18.073180         0.134173
BFGS:    7 12:12:48      -18.080217         0.111519
BFGS:    8 12:12:48      -18.086099         0.092867
BFGS:    9 12:12:49      -18.090538         0.077839
BFGS:   10 12:12:49      -18.093222         0.082055
BFGS:   11 12:12:49      -18.094086         0.097871
BFGS:   12 12:12:49      -18.094693         0.101492
BFGS:   13 12:12:49      -18.096647         0.099395
BFGS:   14 12:12:49      -18.099401         0.081166
BFGS:   15 12:12:49      -18.102541         0.046296
BFGS:   16 12:12:49      -18.104524         0.025096
BFGS:   17 12:12:49      -18.104854         0.007345
BFGS:   18 12:12:49      -18.104894         0.000697
BFGS:   19 12:12:49      -18.104895         0.000216
BFGS:   20 12:12:49      -18.104895         0.000064
BFGS:   21 12:12:49      -18.104895         0.000023
BFGS:   22 12:12:49      -18.104895         0.000003
BFGS:   23 12:12:49      -18.104895         0.000000
BFGS:   24 12:12:49      -18.104895         0.000000
Minimization converged after 24 steps.
Maximum force component: 4.651196277086211e-09 eV/Angstrom
Maximum stress component: 2.3283209769131555e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al', 'Li', 'Li', 'Li', 'Li']
basis =  [[5.05621982e-35 0.00000000e+00 2.50000000e-01]
 [0.00000000e+00 4.60077729e-35 7.50000000e-01]
 [3.33333333e-01 6.66666667e-01 2.50000000e-01]
 [6.66666667e-01 3.33333333e-01 7.50000000e-01]
 [3.33333333e-01 6.66666667e-01 5.98314171e-01]
 [6.66666667e-01 3.33333333e-01 9.83141709e-02]
 [6.66666667e-01 3.33333333e-01 4.01685829e-01]
 [3.33333333e-01 6.66666667e-01 9.01685829e-01]]
cellpar =  Cell([[4.394092922886973, -7.277545127311611e-18, -2.4104949753879135e-38], [-2.1970464614434864, 3.8053960978095347, 2.837879140366586e-38], [-1.966389060600482e-37, -7.287259774414816e-37, 9.217257110625617]])
forces =  [[ 1.00990069e-70  3.74260048e-70 -4.73381106e-33]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-3.15941365e-32  1.56350428e-32  2.40397056e-70]
 [ 8.12420653e-32 -4.69051283e-32 -4.73381106e-33]
 [ 9.92275833e-47  3.67728437e-46 -4.65119628e-09]
 [ 3.38508606e-33 -1.95438035e-33 -4.65119628e-09]
 [ 5.92390060e-33 -2.44297543e-33  4.65119628e-09]
 [ 2.25672404e-33 -3.67732175e-46  4.65119628e-09]]
stress =  [ 1.47399422e-10  1.47399422e-10 -2.32832098e-10  1.17137954e-34
  2.02888888e-34  8.19233214e-27]
energy per atom =  -2.263111881419274
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0